About 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane
4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane (PubChem CID 139921336) has the molecular formula C15H24OSi
and a molecular weight of 248.44 g/mol. Its IUPAC name is 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane.
Molecular Properties
| Compound Name | 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane |
| PubChem CID | 139921336 |
| Molecular Formula | C15H24OSi |
| Molecular Weight | 248.44 g/mol |
| Exact Mass | 248.16 |
| IUPAC Name | 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane |
| SMILES | C=Cc1ccc(CCCC[Si](C)(C)OC)cc1 |
| InChI | InChI=1S/C15H24OSi/c1-5-14-9-11-15(12-10-14)8-6-7-13-17(3,4)16-2/h5,9-12H,1,6-8,13H2,2-4H3 |
| InChIKey | VACCLHOROCTBMQ-UHFFFAOYSA-N |
| XLogP | 4.50 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 248.44 |
| LogP ≤ 5 | 4.50 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
The IUPAC name of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane (CID 139921336) is 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane.
What is the SMILES notation for 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
The canonical SMILES for 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane is C=Cc1ccc(CCCC[Si](C)(C)OC)cc1.
What is the InChIKey of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
The InChIKey is VACCLHOROCTBMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24OSi/c1-5-14-9-11-15(12-10-14)8-6-7-13-17(3,4)16-2/h5,9-12H,1,6-8,13H2,2-4H3.
What are the key properties of 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane?
4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane has a molecular weight of 248.44 g/mol, XLogP of 4.50, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethenylphenyl)butyl-methoxy-dimethylsilane is sourced from PubChem (CID 139921336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).